Basic information
- CAS
72590-07-9- Standard SMILES
COc1ccc(Cc2cc(O)c(OC)cc2O)cc1- InChIKey
YGOYTRWUVFOLIE-UHFFFAOYSA-N- Molecular formula
- C15H16O4
- Average molar mass
- 260.28 g/mol
- Monoisotopic mass
- 260.10485899
Names & identifiers
- Preferred name
- 2-Methoxy-5-[(4-methoxyphenyl)methyl]benzene-1,4-diol
- IUPAC
- 2-methoxy-5-[(4-methoxyphenyl)methyl]benzene-1,4-diol
Names & synonyms
72590-07-92-methoxy-5-[(4-methoxyphenyl)methyl]benzene-1,4-diolNSC269124SCHEMBL14283823DTXSID50313334NSC-269124OBTUSAQUINONE DERIV JURD 2358
Database identifiers
- CAS
72590-07-9- PubChem CID
- 320679
- DTXSID
DTXSID50313334
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 58.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 263
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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